Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.33 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL20597452 | 0.91 | CYP3A4 (0.38) | HSP90AA1CYP3A4CYP2C9CYP2C19CYP19A1 | |
| SCHEMBL20597246 | 0.91 | CYP3A4 (0.38) | HSP90AA1CYP3A4CYP2C9CYP2C19CYP19A1 | |
| SCHEMBL20597170 | 0.91 | CYP3A4 (0.38) | HSP90AA1CYP3A4CYP2C9CYP2C19CYP19A1 | |
| SCHEMBL20537234 | 0.90 | CYP3A4 (0.44) | HSP90AA1CYP3A4CYP2C9CYP2C19CYP19A1 | |
| SCHEMBL20537212 | 0.90 | CYP3A4 (0.44) | HSP90AA1CYP3A4CYP2C9CYP2C19CYP19A1 | |
| SCHEMBL18542630 | 0.90 | CYP3A4 (0.44) | HSP90AA1CYP3A4CYP2C9CYP2C19CYP19A1 | |
| SCHEMBL20537217 | 0.90 | CYP3A4 (0.37) | HSP90AA1CYP3A4CYP2C9CYP2C19CYP19A1 | |
| SCHEMBL20537209 | 0.90 | CYP3A4 (0.37) | HSP90AA1CYP3A4CYP2C9CYP2C19CYP19A1 | |
| SCHEMBL29354915 | 0.90 | CYP3A4 (0.37) | HSP90AA1CYP3A4CYP2C9CYP2C19CYP19A1 | |
| SCHEMBL20471552 | 0.90 | CYP3A4 (0.37) | HSP90AA1CYP3A4CYP2C9CYP2C19CYP19A1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3421460-A1 | 2-[(4-ALKYLPHENOXY)-PYRIDINYL]-1-(1,2,4-TRIAZOL-1-YL)ALKAN-2-OL FUNGICIDES | Bayer Aktiengesellschaft (DE) | 2019-01-02 | — | — | EP | disclosed |